%chk=000135702.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135702

0 1
 O    2.411000       1.724500     -0.2652000    
 N    6.763100      0.2990000     -0.2376000    
 N    3.194900     -0.2405000      0.6840000    
 N   -2.608600       1.195800      5.7999998E-02
 C    5.389900     -0.1612000     -0.3989000    
 C   -1.728000      -1.041200     -4.0600002E-02
 C    4.568600      0.1827000      0.8351000    
 C   -1.559000      0.3516000      3.7400000E-02
 C   0.8517000      6.5000001E-03  7.4900001E-02
 C   -4.127800     -0.6651000     -7.6099999E-02
 C  -0.2607000      0.8514000      9.4099998E-02
 C   -3.034500      -1.537000     -9.7300000E-02
 C   -3.864900      0.7129000      3.1999999E-03
 C  -0.6108000      -1.894300     -5.9999999E-02
 C    2.191800      0.5679000      0.1366000    
 C   0.6768000      -1.369300     -2.3000001E-03
 C   -5.451300      -1.135800     -0.1316000    
 C    7.550100      5.4000001E-03  -1.436900    
 C    7.380300     -0.3190000      0.9375000    
 C   -4.949300       1.586000      2.4599999E-02
 C   -6.517700     -0.2420000     -0.1087000    
 C   -6.265800       1.121700     -3.0400001E-02
 H    5.346400      -1.242700     -0.5868000    
 H    4.937200      0.3273000      -1.271400    
 H    4.587800       1.260900       1.030800    
 H    4.921600     -0.3364000       1.730700    
 H  -0.1201000       1.929700      0.1597000    
 H   -3.202000      -2.611600     -0.1582000    
 H    2.965800      -1.158200       1.050400    
 H  -0.7389000      -2.972400     -0.1272000    
 H    1.508900      -2.064700     -5.1899999E-02
 H   -5.657800      -2.202000     -0.1931000    
 H    7.108500      0.4897000      -2.315100    
 H    7.618200      -1.070800      -1.633600    
 H    8.566000      0.4041000      -1.338900    
 H    6.980500      8.8299997E-02   1.871200    
 H    7.274400      -1.410000      0.9421000    
 H    8.452800     -9.0400003E-02  0.9687000    
 H   -4.777900       2.659300      8.5600004E-02
 H   -7.538700     -0.6083000     -0.1517000    
 H   -7.090800       1.827800     -1.1800000E-02


%chk=000135702-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135702

0 1
O 2.513966 1.558189 -0.241277
N 6.824203 0.255787 -0.155694
N 3.214697 -0.335035 0.906036
N -2.573766 1.169221 -0.158837
C 5.413080 -0.161382 -0.292978
C -1.824919 -1.182113 0.169926
C 4.609228 0.130482 1.001003
C -1.570440 0.249761 0.014792
C 0.851208 -0.158141 0.236729
C -4.220330 -0.697310 -0.044486
C -0.214837 0.721129 0.045958
C -3.167666 -1.626950 0.134015
C -3.866993 0.715957 -0.188341
C -0.704346 -2.068200 0.339429
C 2.244599 0.424201 0.267814
C 0.593496 -1.574050 0.374254
C -5.607358 -1.078476 -0.089445
C 7.446545 0.651621 -1.435060
C 7.651071 -0.713181 0.588597
C -4.921902 1.678857 -0.369456
C -6.598767 -0.118400 -0.266611
C -6.252017 1.272041 -0.407454
H 5.313173 -1.245725 -0.557321
H 4.946315 0.419802 -1.107491
H 4.610841 1.221177 1.165531
H 5.078667 -0.355769 1.874591
H -0.024997 1.790169 -0.085391
H -3.393855 -2.695004 0.245329
H 2.949135 -1.199914 1.376292
H -0.889601 -3.145458 0.428881
H 1.428504 -2.279429 0.462192
H -5.869771 -2.137995 0.018383
H 6.841649 1.441385 -1.913165
H 7.553888 -0.193769 -2.161599
H 8.454457 1.063243 -1.244120
H 7.212172 -0.914718 1.581757
H 7.764270 -1.693421 0.056766
H 8.660205 -0.293733 0.750208
H -4.630612 2.728316 -0.474438
H -7.652852 -0.414823 -0.300197
H -7.048638 2.011257 -0.545820


